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1,8(2H,5H)-Isoquinolinedione, 6,7-dihydro-3-hydroxy-
SpectraBase Compound ID vBMetZk7Gx
InChI InChI=1S/C9H9NO3/c11-6-3-1-2-5-4-7(12)10-9(13)8(5)6/h4H,1-3H2,(H2,10,12,13)
InChIKey VJKJPPQJZHGUQP-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JkIGGXUj5o
Name 1,8(2H,5H)-Isoquinolinedione, 6,7-dihydro-3-hydroxy-
Alternate Name(s) 1,3-Dihydroxy-6,7-dihydro-8(5H)-isoquinolinone
CAS Registry Number 37704-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c11-6-3-1-2-5-4-7(12)10-9(13)8(5)6/h4H,1-3H2,(H2,10,12,13)
InChIKey VJKJPPQJZHGUQP-UHFFFAOYSA-N
Molecular Weight 179.175 g/mol
SMILES N1C(=C2C(=CC1=O)CCCC2=O)O
SPLASH splash10-0fb9-4900000000-27e6db877351f1d3e7c4
Source of Spectrum Y-9-742-1
Wiley ID 17805